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Details

Stereochemistry ACHIRAL
Molecular Formula C21H17F3N4O4S
Molecular Weight 478.444
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[[[2-[(2-Hydroxyacetyl)amino]-4-pyridinyl]methyl]thio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide

SMILES

OCC(=O)NC1=NC=CC(CSC2=NC=CC=C2C(=O)NC3=CC=C(OC(F)(F)F)C=C3)=C1

InChI

InChIKey=KLTZDJNSSCMNAO-UHFFFAOYSA-N
InChI=1S/C21H17F3N4O4S/c22-21(23,24)32-15-5-3-14(4-6-15)27-19(31)16-2-1-8-26-20(16)33-12-13-7-9-25-17(10-13)28-18(30)11-29/h1-10,29H,11-12H2,(H,27,31)(H,25,28,30)

HIDE SMILES / InChI

Molecular Formula C21H17F3N4O4S
Molecular Weight 478.444
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:25:50 GMT 2025
Edited
by admin
on Mon Mar 31 23:25:50 GMT 2025
Record UNII
8IIH435GP6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[[[2-[(2-Hydroxyacetyl)amino]-4-pyridinyl]methyl]thio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide
Systematic Name English
2-({[2-(2-Hydroxyacetamido)pyridin-4-yl]methyl}sulfanyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
Preferred Name English
Code System Code Type Description
FDA UNII
8IIH435GP6
Created by admin on Mon Mar 31 23:25:50 GMT 2025 , Edited by admin on Mon Mar 31 23:25:50 GMT 2025
PRIMARY
PUBCHEM
11420188
Created by admin on Mon Mar 31 23:25:50 GMT 2025 , Edited by admin on Mon Mar 31 23:25:50 GMT 2025
PRIMARY
CAS
864458-92-4
Created by admin on Mon Mar 31 23:25:50 GMT 2025 , Edited by admin on Mon Mar 31 23:25:50 GMT 2025
PRIMARY